@MOLECULE (1s,6s,7s,8r)-6-hydroxy-2,4'-dimethyl-3'h,4h,12h-spiro[5,11-dioxatricyclo[5.3.2.0~1,6~]dodec-2-ene-8,2'-furan]-3',4,12-trione 36 39 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.0509 -1.5106 -0.6692 O.3 1 UNL111111111 -0.3925 2 O 1.6853 1.3783 -0.8049 O.3 1 UNL111111111 -0.4857 3 O -1.7598 1.0549 1.1841 O.2 1 UNL111111111 -0.3047 4 O 0.7340 1.4669 1.2423 O.3 1 UNL111111111 -0.5299 5 O -0.2592 -1.3603 -2.4726 O.2 1 UNL111111111 -0.3546 6 O -3.0687 -1.3749 -1.0025 O.2 1 UNL111111111 -0.3735 7 O 3.6880 2.1390 -1.2236 O.2 1 UNL111111111 -0.4031 8 C 1.3426 -0.7244 0.4976 C.3 1 UNL111111111 0.1578 9 C -0.4363 0.3365 -0.6743 C.3 1 UNL111111111 -0.3234 10 C 0.8541 0.7098 0.0989 C.3 1 UNL111111111 0.4513 11 C -1.4817 -0.0983 0.3493 C.3 1 UNL111111111 0.1193 12 C 0.4616 -1.1987 1.6536 C.3 1 UNL111111111 -0.2905 13 C -1.0218 -1.2478 1.2455 C.3 1 UNL111111111 -0.2952 14 C 0.0543 -0.9015 -1.4226 C.2 1 UNL111111111 0.5818 15 C 2.8305 -0.7815 0.6767 C.2 1 UNL111111111 0.1258 16 C -2.8593 -0.4249 -0.3106 C.2 1 UNL111111111 0.4173 17 C 3.5927 0.1882 0.1513 C.2 1 UNL111111111 -0.3370 18 C -3.7608 0.6373 0.1631 C.2 1 UNL111111111 -0.2567 19 C 3.0598 1.3009 -0.6409 C.2 1 UNL111111111 0.6288 20 C 3.3872 -1.9441 1.4073 C.3 1 UNL111111111 -0.4640 21 C -3.0633 1.4253 1.0092 C.2 1 UNL111111111 0.1172 22 C -5.1619 0.7348 -0.2679 C.3 1 UNL111111111 -0.4006 23 H -0.7923 1.1328 -1.3574 H 1 UNL111111111 0.2089 24 H 0.7763 -2.2030 1.9973 H 1 UNL111111111 0.1586 25 H 0.5959 -0.5146 2.5202 H 1 UNL111111111 0.1774 26 H -1.6499 -1.2751 2.1602 H 1 UNL111111111 0.1659 27 H -1.2202 -2.2084 0.7137 H 1 UNL111111111 0.1789 28 H 0.3445 2.3545 1.0537 H 1 UNL111111111 0.3526 29 H 4.6805 0.2013 0.2559 H 1 UNL111111111 0.1954 30 H 2.9869 -2.8932 1.0079 H 1 UNL111111111 0.1812 31 H 4.4837 -2.0097 1.3378 H 1 UNL111111111 0.1689 32 H 3.1381 -1.9095 2.4798 H 1 UNL111111111 0.1698 33 H -3.3140 2.2919 1.5928 H 1 UNL111111111 0.1731 34 H -5.6352 -0.2606 -0.3324 H 1 UNL111111111 0.1681 35 H -5.7758 1.3439 0.4093 H 1 UNL111111111 0.1491 36 H -5.2429 1.1801 -1.2746 H 1 UNL111111111 0.1644 @BOND 1 1 8 1 2 1 14 1 3 2 10 1 4 2 19 1 5 3 11 1 6 3 21 1 7 4 10 1 8 4 28 1 9 5 14 2 10 6 16 2 11 7 19 2 12 8 10 1 13 8 12 1 14 8 15 1 15 9 10 1 16 9 11 1 17 9 14 1 18 9 23 1 19 11 13 1 20 11 16 1 21 12 13 1 22 12 24 1 23 12 25 1 24 13 26 1 25 13 27 1 26 15 17 2 27 15 20 1 28 16 18 1 29 17 19 1 30 17 29 1 31 18 21 2 32 18 22 1 33 20 30 1 34 20 31 1 35 20 32 1 36 21 33 1 37 22 34 1 38 22 35 1 39 22 36 1